In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 28 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.03 | 10.04 | -97.94 | 3 | 8 | 2 | 87 | 391.516 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 7.58 | -46.55 | 2 | 8 | 1 | 86 | 390.508 | 6 | ↓ |